1-[2-(3-chloranylphenoxy)ethyl]-4-(2-methylphenyl)piperazine-1,4-diium

Systemtic Name: 1-[2-(3-chloranylphenoxy)ethyl]-4-(2-methylphenyl)piperazine-1,4-diium Openeye Name: 1-[2-(3-chlorophenoxy)ethyl]-4-(o-tolyl)piperazine-1,4-diium CAS Name: 1-[2-(3-chlorophenoxy)ethyl]-4-(2-methylphenyl)piperazine-1,4-diium IUPAC Name: 1-[2-(3-chlorophenoxy)ethyl]-4-(2-methylphenyl)piperazine-1,4-diium Traditional Name: 1-[2-(3-chlorophenoxy)ethyl]-4-(o-tolyl)piperazine-1,4-diium Formula: C19H25ClN2O+2 MolecularWeight: 332.8676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1[NH+]2CC[NH+](CC2)CCOC3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1[NH+]2CC[NH+](CC2)CCOC3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H23ClN2O/c1-16-5-2-3-8-19(16)22-11-9-21(10-12-22)13-14-23-18-7-4-6-17(20)15-18/h2-8,15H,9-14H2,1H3/p+2